The old spectral displacement method can be suitably revitalized for a didactic experimental approach to fundamental concepts of supramolecular chemistry and to the study of complex equilibria in general. In particular, the case of the β-cyclodextrin/phenolphthalein/adamantane ternary system has been taken into account as a viable and impressive example due to the remarkable color changes that can be observed when performing the experiments. A new method for data regression analysis is proposed, with a smart trick able to overcome the mathematical difficulties arising whenever multiple equilibria must be considered. Hence, some aspects of the reliability of fitting procedures are discussed.

Revisiting the Spectral Displacement Method for Estimation of the Binding Constants in Systems Involving Multiple Equilibria

Marco Russo
Primo
;
2025

Abstract

The old spectral displacement method can be suitably revitalized for a didactic experimental approach to fundamental concepts of supramolecular chemistry and to the study of complex equilibria in general. In particular, the case of the β-cyclodextrin/phenolphthalein/adamantane ternary system has been taken into account as a viable and impressive example due to the remarkable color changes that can be observed when performing the experiments. A new method for data regression analysis is proposed, with a smart trick able to overcome the mathematical difficulties arising whenever multiple equilibria must be considered. Hence, some aspects of the reliability of fitting procedures are discussed.
2025
Istituto per lo Studio dei Materiali Nanostrutturati - ISMN
equilibrium
noncovalent interactions
organic chemistry
problem solving
upper-division undergraduate
UV-Vis spectroscopy
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Utilizza questo identificativo per citare o creare un link a questo documento: https://hdl.handle.net/20.500.14243/562941
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